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Merge pull request #1972 from jamesmkrieger/clustenm_fixes
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clustenm fixes
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jamesmkrieger authored Nov 15, 2024
2 parents ca4cad9 + e5d2048 commit fcf1360
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion prody/dynamics/clustenm.py
Original file line number Diff line number Diff line change
Expand Up @@ -1076,7 +1076,7 @@ def run(self, cutoff=15., n_modes=3, gamma=1., n_confs=50, rmsd=1.0,
self._sparse = kwargs.get('sparse', False)
self._kdtree = kwargs.get('kdtree', False)
self._turbo = kwargs.get('turbo', False)
self._nproc = kwargs.pop('nproc', None)
self._nproc = kwargs.pop('nproc', 0)
if kwargs.get('zeros', False):
LOGGER.warn('ClustENM cannot use zero modes so ignoring this kwarg')

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